SCHEMBL7792232

SCHEMBL7792232

COc1ccc(OCCCC2CCNC2)c2c1-c1c(OCCCC3CCNC3)cccc1C2=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 4/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
DUSP3 P51452 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KCNA3 P22001 1/20 0.39
EGFR P00533 1/20 0.39
PIM1 P11309 1/20 0.39
HTR2A P28223 4/20 0.38
HTR2C P28335 4/20 0.38
HTR2B P41595 4/20 0.38
ACP1 P24666 1/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
FGB P02675 1/20 0.37
POLB P06746 1/20 0.37
THRB P10828 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7794665 0.94 ACP1 (0.43) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL7786436 0.91 HTR2A (0.45) KCNA3HTR2AHTR2CHTR2BACP1
SCHEMBL7792607 0.91 HTR2A (0.42) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL7794753 0.91 HTR2A (0.41) KCNA3HTR2AHTR2CHTR2BACP1
SCHEMBL7792073 0.88 KCNA3 (0.35) MEN1KMT2AKCNA3EGFRPIM1
SCHEMBL7792629 0.88 ACP1 (0.45) MEN1KMT2AKCNA3ACP1NPY1R
SCHEMBL7786255 0.85 KCNA3 (0.41) MEN1KMT2AALDH1A1KCNA3HTR2A
SCHEMBL7796614 0.85 ALDH1A1 (0.42) MEN1KMT2AALDH1A1KCNA3HTR2A
SCHEMBL7792363 0.85 HTR2A (0.47) KCNA3HTR2AHTR2CHTR2BNPY1R
SCHEMBL7796210 0.85 HTR2A (0.44) KCNA3HTR2AHTR2CHTR2BNPY1R

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0906268-B1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS AVENTIS PHARMA INC (US) 2001-11-28 EP disclosed
US-6004959-A HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed
EP-0906268-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-04-07 EP disclosed
WO-1997045397-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-12-04 WO disclosed